1-(4-methylbenzene-1-sulfonyl)-4-[4-nitro-3-(pyrrolidin-1-yl)phenyl]piperazine
Chemical Structure Depiction of
1-(4-methylbenzene-1-sulfonyl)-4-[4-nitro-3-(pyrrolidin-1-yl)phenyl]piperazine
1-(4-methylbenzene-1-sulfonyl)-4-[4-nitro-3-(pyrrolidin-1-yl)phenyl]piperazine
Compound characteristics
| Compound ID: | 8011-7043 |
| Compound Name: | 1-(4-methylbenzene-1-sulfonyl)-4-[4-nitro-3-(pyrrolidin-1-yl)phenyl]piperazine |
| Molecular Weight: | 430.52 |
| Molecular Formula: | C21 H26 N4 O4 S |
| Smiles: | Cc1ccc(cc1)S(N1CCN(CC1)c1ccc(c(c1)N1CCCC1)[N+]([O-])=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0103 |
| logD: | 4.0103 |
| logSw: | -4.1923 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 71.808 |
| InChI Key: | DVURWEUNPUBOEX-UHFFFAOYSA-N |